Adipic Acid

Adipic Acid

SCHEMBL11001007

O=C(O)CCCCC(=O)O.O=C1C=CC(=O)O1

nearest known ligand 0.52

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

SLC18A2SLC6A2SLC6A3

The experimentally established mechanism targets of Adipic Acid. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.52
NFKB1 P19838 2/20 0.50
TSHR P16473 2/20 0.50
PMP22 Q01453 1/20 0.50
PTGS1 P23219 4/20 0.48
PTGS2 P35354 4/20 0.48
F13A1 P00488 3/20 0.47
SLC22A6 Q4U2R8 2/20 0.46
GPR84 Q9NQS5 2/20 0.42
FFAR1 O14842 1/20 0.42
FFAR4 Q5NUL3 1/20 0.42
AKR1B1 P15121 1/20 0.42
CYP2D6 P10635 1/20 0.42
FOLH1 Q04609 1/20 0.42
MAPT P10636 1/20 0.42
RXFP1 Q9HBX9 1/20 0.42
HDAC3 O15379 1/20 0.42
HDAC4 P56524 1/20 0.42
HDAC1 Q13547 1/20 0.42
HDAC7 Q8WUI4 1/20 0.42

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
Sebacic Acid SCHEMBL3454140 0.98 TSHR (0.55) LMNANFKB1TSHRPMP22PTGS1
Sebacic Acid SCHEMBL8856373 0.98 TSHR (0.55) LMNANFKB1TSHRPMP22PTGS1
Adipic Acid SCHEMBL9696395 0.96 LMNA (0.48) LMNANFKB1TSHRPMP22PTGS1
Sebacic Acid SCHEMBL27554744 0.92 GPR84 (0.52) LMNANFKB1TSHRPMP22PTGS1
Succinic Acid SCHEMBL8472894 0.90 LMNA (0.47) LMNAPTGS1PTGS2F13A1SLC22A6
Dodecanoate SCHEMBL30877485 0.88 GPR84 (0.63) LMNATSHRSLC22A6GPR84FFAR1
Valeric Acid SCHEMBL5438662 0.87 AKR1B1 (0.52) TSHRSLC22A6GPR84FFAR1FFAR4
Maleic Anhydride SCHEMBL11253459 0.87 PTGS1 (0.43) LMNANFKB1TSHRPMP22PTGS1
Adipic Acid SCHEMBL735379 0.85 PTGS1 (0.39) LMNANFKB1TSHRPMP22PTGS1
Maleic Anhydride SCHEMBL1286835 0.84 TSHR (0.44) LMNANFKB1TSHRPMP22PTGS1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115894854-A Waterborne polyurethane surface layer resin and preparation method and application thereof 旭川化学(苏州)有限公司 2023-04-04 CN claimed
CN-115894854-A Waterborne polyurethane surface layer resin and preparation method and application thereof 旭川化学(苏州)有限公司 2023-04-04 CN disclosed
CN-104837637-A Fabric pretreatment for digital printing LUBRIZOL ADVANCED MAT INC 2015-08-12 CN disclosed
CN-101613457-B Breathable polyurethanes, blends, and articles LUBRIZOL ADVANCED MAT INC 2012-10-17 CN disclosed
CN-102575051-A Hydrolytically stable polyurethane nanocomposites LUBRIZOL ADVANCED MAT INC 2012-07-11 CN disclosed
US-4496675-A Aqueous dispersions based on a polyurethane synthetic resin BASF FARBEN & FASERN AG (DE) 1985-01-29 US disclosed